HRID290539

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID185949

2(1H)-Quinoxalinone, 3,4-dihydro-

C8H8N2O

HCID22450243

3-{[(tert-Butoxycarbonyl)(methyl)amino]methyl}benzoic acid

C14H19NO4

PRODUCTS

生成物

结构：CN(Cc1cccc(C(=O)N2CC(=O)Nc3ccccc32)c1)C(=O)OC(C)(C)C

HCID69208344

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-febe7d8d6142452089c46bc4646afac8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1](=[O:2])([OH:3])[c:4]1[cH:5][c:6]([CH2:7][N:8]([C:9]([O:10][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:15])[CH3:16])[cH:17][cH:18][cH:19]1.[CH3:31][N:32]([CH3:33])[c:34]1[cH:35][cH:36][n:37][cH:38][cH:39]1.[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl:40][CH2:41][Cl:42].[NH:20]1[C:21](=[O:30])[CH2:22][NH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]21>>[C:1](=[O:3])([c:4]1[cH:5][c:6]([CH2:7][N:8]([C:9]([O:10][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:15])[CH3:16])[cH:17][cH:18][cH:19]1)[N:23]1[CH2:22][C:21](=[O:30])[NH:20][c:29]2[c:24]1[cH:25][cH:26][cH:27][cH:28]2